Geometry & MOs

Info

ID:	365709
PubChem CID:	127318434
Reduced:	O3N4C19H30 (1)
Stoich.:	A3B4C19D30 (1)
Weight, g/mol:	383.151492
ΔH_f, kcal/mol:	-86.51
Dipole, Da:	4.28
IP(EA), eV:	-9.08(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-1,4-diazepan-1-yl]-(7-oxabicyclo[2.2.1]heptan-2-yl)methanone

Drug info:

PubChemData

Smile

CC(C)C1=NOC(=C1)C(=O)N2CCN(CC2)CC(=O)N3CCCCCC3

DOS

IR

Vibrations